| SpectraBase Compound ID | 85Vhgo2ZOtR |
|---|---|
| InChI | InChI=1S/C23H39NO/c1-6-15-7-9-17-16-8-10-19-21(25)20(24(4)5)12-14-23(19,3)18(16)11-13-22(15,17)2/h10,15-18,20-21,25H,6-9,11-14H2,1-5H3/t15?,16?,17?,18?,20-,21+,22+,23+/m0/s1 |
| InChIKey | GTCGMIZVFGTXIK-BDONJTKPSA-N |
| Mol Weight | 345.6 g/mol |
| Molecular Formula | C23H39NO |
| Exact Mass | 345.303165 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LKF1gTxfgYG |
|---|---|
| Name | 3.beta.-dimethylamino-4.beta.-hydroxy-5-pregnane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H39NO |
| InChI | InChI=1S/C23H39NO/c1-6-15-7-9-17-16-8-10-19-21(25)20(24(4)5)12-14-23(19,3)18(16)11-13-22(15,17)2/h10,15-18,20-21,25H,6-9,11-14H2,1-5H3/t15?,16?,17?,18?,20-,21+,22+,23+/m0/s1 |
| InChIKey | GTCGMIZVFGTXIK-BDONJTKPSA-N |
| Molecular Weight | 345.571 g/mol |
| SMILES | O[C@@]1(C=2[C@@](C3CC[C@]4(C(C3CC2)CCC4CC)C)(CC[C@@]1(N(C)C)[H])C)[H] |
| SPLASH | splash10-001i-9000000000-f58c9b7979763733918b |
| Source of Spectrum | PL-1982-0-0 |
| Synonyms | (3beta,4beta)-3-(dimethylamino)pregn-5-en-4-ol |
| Wiley ID | 1338820 |